Basic information
- Standard SMILES
O=C(c1cnoc1-c1ccccn1)N1CC(CO)[C@H](c2ccccc2)C1- InChIKey
RPZHFIPFOVVEAN-LWKPJOBUSA-N- Molecular formula
- C20H19N3O3
- Average molar mass
- 349.4 g/mol
Names & identifiers
- Preferred name
- {(4R)-4-phenyl-1-[(5-pyridin-2-ylisoxazol-4-yl)carbonyl]pyrrolidin-3-yl}methanol
- IUPAC
- [(4R)-3-(hydroxymethyl)-4-phenylpyrrolidin-1-yl]-(5-pyridin-2-yl-1,2-oxazol-4-yl)methanone
Names & synonyms
SCHEMBL3541997RPZHFIPFOVVEAN-LWKPJOBUSA-N{(4R)-4-phenyl-1-[(5-pyridin-2-ylisoxazol-4-yl)carbonyl]pyrrolidin-3-yl}methanol
Database identifiers
- PubChem CID
- 68683047
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 483
Related reactions
1 records
Compound notes
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